| SpectraBase Compound ID | 2WIAJEidFso |
|---|---|
| InChI | InChI=1S/C31H43NO7/c1-7-8-9-10-13-22(3)25(33)18-16-21(2)15-17-24(5)29(35)28-26(34)20-27(39-30(28)36)23(4)14-11-12-19-32-31(37)38-6/h8-9,12-13,15,17,19-20,23,25,33-34H,7,10-11,14,16,18H2,1-6H3,(H,32,37)/b9-8+,19-12+,21-15+,22-13+,24-17+ |
| InChIKey | XWTHWSMCSBXZRJ-PVFBWGNESA-N |
| Mol Weight | 541.7 g/mol |
| Molecular Formula | C31H43NO7 |
| Exact Mass | 541.303953 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EvcaT6xCPbY |
|---|---|
| Name | Corallopyronin-B |
| CAS Registry Number | 93195-33-6 |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C31H43NO7 |
| InChI | InChI=1S/C31H43NO7/c1-7-8-9-10-13-22(3)25(33)18-16-21(2)15-17-24(5)29(35)28-26(34)20-27(39-30(28)36)23(4)14-11-12-19-32-31(37)38-6/h8-9,12-13,15,17,19-20,23,25,33-34H,7,10-11,14,16,18H2,1-6H3,(H,32,37)/b9-8+,19-12+,21-15+,22-13+,24-17+ |
| InChIKey | XWTHWSMCSBXZRJ-PVFBWGNESA-N |
| Instrument Name | SF = 400 MHz |
| Literature Reference | Liebigs Ann. Chem. 822 (1985). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CD3OD |